#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wuz s ASN 2 N 0.00 6.30 0.00 1.61 3.84 -1.25 -5.01 114.94 120.43 1wuz s ASN 2 Ca 0.00 1.19 0.00 0.00 0.21 0.00 0.00 52.86 54.26 1wuz s ASN 2 Cb 0.00 -2.36 0.00 0.00 -0.55 0.00 0.00 41.25 38.34 1wuz s ASN 2 CO 0.00 -0.68 0.00 -1.54 -2.79 0.00 0.00 177.10 172.09 1wuz n SER 3 N -2.32 0.68 -4.58 -4.21 3.41 -1.26 -4.93 113.62 100.42 1wuz n SER 3 Ca 0.03 0.00 -0.43 0.00 -0.26 0.00 0.00 58.87 58.22 1wuz n SER 3 Cb 0.54 0.00 -0.03 0.00 -0.26 0.00 0.00 64.21 64.47 1wuz n SER 3 CO 0.00 0.00 0.00 -1.58 -0.16 0.00 0.00 175.04 173.30 1wuz s GLN 4 N -1.92 3.58 0.01 4.33 2.00 -1.26 -1.32 119.66 125.07 1wuz s GLN 4 Ca 0.00 0.29 0.02 0.00 -2.00 0.00 0.00 55.36 53.67 1wuz s GLN 4 Cb 0.00 -3.95 -0.01 0.00 0.80 0.00 0.00 33.01 29.84 1wuz s GLN 4 CO 0.00 -1.42 -0.07 0.42 -0.50 0.00 0.00 175.29 173.71 1wuz s ILE 5 N 4.33 0.57 0.03 -2.34 -1.09 -0.57 -5.02 121.20 117.11 1wuz s ILE 5 Ca 0.42 -0.59 0.00 0.00 -2.23 0.00 0.00 60.65 58.25 1wuz s ILE 5 Cb -0.09 -0.53 -0.03 0.00 -1.58 0.00 0.00 42.46 40.24 1wuz s ILE 5 CO 0.28 -0.03 -0.04 -1.38 -1.23 0.00 0.00 174.94 172.53 1wuz s HIS 6 N -0.59 0.41 0.26 3.97 -3.43 -1.26 -1.08 115.29 113.57 1wuz s HIS 6 Ca -0.01 -0.68 0.07 0.00 -0.80 0.00 0.00 55.06 53.64 1wuz s HIS 6 Cb -0.05 -0.28 -0.05 0.00 -1.43 0.00 0.00 32.58 30.76 1wuz s HIS 6 CO 0.00 -0.22 -0.09 0.71 -2.00 0.00 0.00 174.74 173.15 1wuz s TYR 7 N -2.17 1.87 -0.18 0.38 2.02 0.19 -4.89 117.35 114.57 1wuz s TYR 7 Ca -0.08 -0.66 0.00 0.00 -0.37 0.00 0.00 57.07 55.96 1wuz s TYR 7 Cb -0.05 -1.01 0.01 0.00 -0.40 0.00 0.00 41.96 40.52 1wuz s TYR 7 CO -0.03 0.30 -0.17 -1.12 -1.57 0.00 0.00 175.55 172.96 1wuz s SER 8 N -3.40 3.35 -0.04 2.29 0.01 -0.84 -2.69 113.70 112.39 1wuz s SER 8 Ca 0.27 -0.59 0.00 0.00 1.31 0.00 0.00 55.95 56.94 1wuz s SER 8 Cb 0.02 -1.52 0.03 0.00 0.21 0.00 0.00 66.02 64.75 1wuz s SER 8 CO 0.10 0.01 -0.00 -0.51 0.41 0.00 0.00 173.24 173.25 1wuz s ILE 9 N 1.24 0.23 0.23 1.44 -1.16 -1.05 -4.50 121.20 117.63 1wuz s ILE 9 Ca 0.03 0.09 -0.30 0.00 -0.51 0.00 0.00 60.65 59.97 1wuz s ILE 9 Cb -0.14 -0.34 -0.09 0.00 0.61 0.00 0.00 42.46 42.50 1wuz s ILE 9 CO -0.09 0.18 1.28 -2.16 -2.81 0.00 0.00 174.94 171.33 1wuz s PRO 10 N 1.25 4.41 0.65 3.50 0.04 -1.26 -2.37 135.00 141.22 1wuz s PRO 10 Ca -0.06 2.05 -0.17 0.00 0.04 0.00 0.00 61.00 62.85 1wuz s PRO 10 Cb -0.13 -3.17 -0.07 0.00 0.04 0.00 0.00 34.50 31.16 1wuz s PRO 10 CO -0.02 -0.18 0.42 0.39 0.04 0.00 0.00 177.00 177.65 1wuz n GLU 11 N 2.15 0.35 -3.29 4.56 1.02 -1.03 -2.96 120.64 121.44 1wuz n GLU 11 Ca 0.04 0.15 -0.17 0.00 -0.02 0.00 0.00 57.16 57.16 1wuz n GLU 11 Cb 0.43 -1.67 0.07 0.00 -0.02 0.00 0.00 31.44 30.24 1wuz n GLU 11 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 1wuz n GLU 12 N -0.13 -6.01 -3.00 3.49 2.13 -1.26 -4.95 120.64 110.92 1wuz n GLU 12 Ca 0.10 0.67 -0.43 0.00 0.66 0.00 0.00 57.16 58.16 1wuz n GLU 12 Cb 0.49 -5.21 -0.06 0.00 0.27 0.00 0.00 31.44 26.93 1wuz n GLU 12 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1wuz s ALA 13 N -3.27 3.30 0.70 4.31 0.00 -1.16 -4.95 121.76 120.70 1wuz s ALA 13 Ca 0.30 -1.06 -0.16 0.00 0.00 0.00 0.00 51.96 51.04 1wuz s ALA 13 Cb -0.13 -3.44 0.01 0.00 0.00 0.00 0.00 23.12 19.56 1wuz s ALA 13 CO 0.58 -1.90 1.15 0.36 0.00 0.00 0.00 175.76 175.95 1wuz n LYS 14 N 6.62 0.73 -1.69 0.00 2.85 -1.26 -4.69 118.16 120.72 1wuz n LYS 14 Ca 0.01 0.31 -0.52 0.00 -1.05 0.00 0.00 58.31 57.06 1wuz n LYS 14 Cb 0.48 -2.39 -0.06 0.00 -0.65 0.00 0.00 35.03 32.42 1wuz n LYS 14 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07 1wuz n HIS 15 N -2.34 2.17 0.00 5.58 8.25 -1.26 -1.54 115.22 126.08 1wuz n HIS 15 Ca 0.14 0.27 0.00 0.00 -0.26 0.00 0.00 57.72 57.87 1wuz n HIS 15 Cb 0.49 -2.56 0.00 0.00 1.12 0.00 0.00 29.99 29.04 1wuz n HIS 15 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1wuz n GLY 16 N 4.18 1.07 3.76 -1.41 0.00 -0.84 -4.96 105.19 107.00 1wuz n GLY 16 Ca 0.24 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.87 1wuz n GLY 16 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1wuz s THR 17 N -2.00 4.05 0.27 2.61 2.01 -0.59 -4.70 115.64 117.29 1wuz s THR 17 Ca 0.00 1.91 -0.30 0.00 0.31 0.00 0.00 61.69 63.61 1wuz s THR 17 Cb 0.00 -4.16 -0.10 0.00 0.01 0.00 0.00 72.50 68.25 1wuz s THR 17 CO 0.00 0.34 1.44 0.12 -0.69 0.00 0.00 174.62 175.83 1wuz s PHE 18 N -1.35 2.97 0.00 4.92 5.36 -1.26 -1.32 117.98 127.30 1wuz s PHE 18 Ca 0.45 1.06 0.00 0.00 -0.96 0.00 0.00 56.93 57.48 1wuz s PHE 18 Cb -0.24 -3.84 0.00 0.00 -0.34 0.00 0.00 43.02 38.60 1wuz s PHE 18 CO 0.30 -2.69 0.00 0.28 -1.46 0.00 0.00 175.22 171.65 1wuz n VAL 19 N 2.02 0.00 0.00 3.12 0.31 -0.32 -4.75 118.33 118.71 1wuz n VAL 19 Ca 0.06 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.39 1wuz n VAL 19 Cb 0.40 -0.90 0.00 0.00 -0.91 0.00 0.00 33.84 32.43 1wuz n VAL 19 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1wuz n GLY 20 N 3.07 0.02 3.37 2.92 0.00 -1.25 -1.98 105.19 111.34 1wuz n GLY 20 Ca 0.00 -1.02 -0.45 0.00 0.00 0.00 0.00 46.02 44.56 1wuz n GLY 20 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wuz n ARG 21 N -0.36 3.51 -0.27 1.61 1.74 -1.26 -1.19 116.66 120.44 1wuz n ARG 21 Ca 0.00 -4.21 0.06 0.00 -0.77 0.00 0.00 57.85 52.93 1wuz n ARG 21 Cb 0.00 -2.74 0.20 0.00 -1.02 0.00 0.00 32.46 28.90 1wuz n ARG 21 CO 0.00 0.00 0.00 0.97 -1.52 0.00 0.00 177.63 177.08 1wuz h ILE 22 N 4.02 0.66 0.12 0.55 2.10 -1.91 0.23 117.51 123.27 1wuz h ILE 22 Ca 0.24 -0.16 -0.01 0.00 1.08 0.00 0.00 64.86 66.01 1wuz h ILE 22 Cb 0.86 0.14 0.00 0.00 -1.09 0.00 0.00 36.82 36.73 1wuz h ILE 22 CO 1.13 0.09 -0.06 0.00 -1.08 0.00 0.00 178.15 178.23 1wuz h ALA 23 N 1.56 -0.16 -1.00 0.18 0.00 -1.88 -0.44 119.26 117.51 1wuz h ALA 23 Ca 0.43 -0.21 0.13 0.00 0.00 0.00 0.00 54.91 55.26 1wuz h ALA 23 Cb 0.66 0.06 -0.09 0.00 0.00 0.00 0.00 17.79 18.42 1wuz h ALA 23 CO -0.40 -0.36 0.63 0.37 0.00 0.00 0.00 179.25 179.49 1wuz h GLN 24 N -0.62 0.93 -0.01 0.00 5.75 -1.66 0.19 115.11 119.70 1wuz h GLN 24 Ca -0.02 -0.06 -0.17 0.00 -0.15 0.00 0.00 58.65 58.26 1wuz h GLN 24 Cb 0.48 -0.21 -0.02 0.00 1.07 0.00 0.00 27.48 28.80 1wuz h GLN 24 CO 0.03 0.62 -0.77 -0.44 -2.65 0.00 0.00 178.83 175.61 1wuz h ASP 25 N 0.96 0.10 -0.19 -0.69 3.32 -0.55 -3.22 116.42 116.14 1wuz h ASP 25 Ca 0.51 -0.07 -0.19 0.00 0.02 0.00 0.00 57.03 57.29 1wuz h ASP 25 Cb 0.55 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 40.07 1wuz h ASP 25 CO -0.28 0.83 -0.59 -0.07 -1.72 0.00 0.00 179.24 177.41 1wuz h LEU 26 N 0.05 0.90 -0.55 1.55 4.07 0.73 -3.44 115.31 118.62 1wuz h LEU 26 Ca -0.02 -0.50 0.00 0.00 0.08 0.00 0.00 57.88 57.44 1wuz h LEU 26 Cb 1.35 -0.26 0.00 0.00 1.08 0.00 0.00 40.66 42.83 1wuz h LEU 26 CO 0.11 1.29 0.00 0.61 -1.08 0.00 0.00 178.44 179.37 1wuz n GLY 27 N 0.41 0.80 3.31 0.83 0.00 0.49 -3.75 105.19 107.28 1wuz n GLY 27 Ca -0.05 -0.25 -0.16 0.00 0.00 0.00 0.00 46.02 45.56 1wuz n GLY 27 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1wuz s LEU 28 N -0.55 2.38 0.32 0.99 1.43 -1.22 -5.02 118.68 117.00 1wuz s LEU 28 Ca 0.00 -1.12 -0.27 0.00 -1.03 0.00 0.00 54.13 51.71 1wuz s LEU 28 Cb 0.00 -0.36 -0.09 0.00 0.03 0.00 0.00 46.19 45.77 1wuz s LEU 28 CO 0.00 -0.40 1.02 -0.70 0.23 0.00 0.00 176.35 176.50 1wuz s GLU 29 N -3.79 4.52 0.22 1.70 2.12 -1.26 -4.74 118.70 117.47 1wuz s GLU 29 Ca 0.23 1.54 -0.09 0.00 0.36 0.00 0.00 54.97 57.02 1wuz s GLU 29 Cb 0.04 -2.91 0.18 0.00 0.26 0.00 0.00 34.13 31.70 1wuz s GLU 29 CO 0.05 0.18 1.87 1.25 -0.54 0.00 0.00 175.26 178.07 1wuz h LEU 30 N 3.31 0.99 -0.49 2.70 7.12 -1.97 -1.03 115.31 125.94 1wuz h LEU 30 Ca -0.47 -0.06 0.00 0.00 0.13 0.00 0.00 57.88 57.48 1wuz h LEU 30 Cb 1.21 -0.25 0.00 0.00 -0.53 0.00 0.00 40.66 41.09 1wuz h LEU 30 CO 0.65 0.76 0.00 0.35 -0.13 0.00 0.00 178.44 180.07 1wuz n THR 31 N -4.45 0.07 0.95 1.05 -2.24 -1.26 -3.27 114.28 105.12 1wuz n THR 31 Ca 0.08 -0.15 0.11 0.00 -2.27 0.00 0.00 64.05 61.82 1wuz n THR 31 Cb 0.05 0.00 0.05 0.00 -2.10 0.00 0.00 70.33 68.33 1wuz n THR 31 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1wuz n GLU 32 N -0.33 0.03 -0.09 -0.78 1.02 -0.40 -4.17 120.64 115.92 1wuz n GLU 32 Ca 0.17 -0.00 -0.08 0.00 -0.02 0.00 0.00 57.16 57.23 1wuz n GLU 32 Cb 0.20 -1.51 0.08 0.00 -0.02 0.00 0.00 31.44 30.20 1wuz n GLU 32 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 1wuz h LEU 33 N 0.00 0.80 0.24 -4.62 3.38 -1.52 -2.17 115.31 111.42 1wuz h LEU 33 Ca 0.00 -0.29 0.01 0.00 0.09 0.00 0.00 57.88 57.69 1wuz h LEU 33 Cb 0.53 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 41.02 1wuz h LEU 33 CO 0.00 1.00 -0.47 0.58 0.09 0.00 0.00 178.44 179.64 1wuz h VAL 34 N 0.68 0.09 0.00 1.22 2.07 -1.80 -1.38 116.25 117.13 1wuz h VAL 34 Ca 0.09 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.61 1wuz h VAL 34 Cb 0.74 0.09 0.00 0.00 -1.52 0.00 0.00 31.29 30.59 1wuz h VAL 34 CO 0.06 0.00 0.00 1.55 0.02 0.00 0.00 177.57 179.20 1wuz h PRO 35 N -0.78 0.00 -0.05 1.57 0.13 -1.80 -2.27 132.00 128.80 1wuz h PRO 35 Ca -0.01 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.12 1wuz h PRO 35 Cb 0.75 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.88 1wuz h PRO 35 CO -0.19 0.00 0.00 0.54 -0.23 0.00 0.00 178.00 178.12 1wuz n ARG 36 N -2.45 1.67 -3.89 0.86 3.00 -0.61 -4.81 116.66 110.42 1wuz n ARG 36 Ca 0.02 -0.98 -0.32 0.00 -0.01 0.00 0.00 57.85 56.55 1wuz n ARG 36 Cb 0.24 -1.46 0.01 0.00 0.00 0.00 0.00 32.46 31.25 1wuz n ARG 36 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 1wuz n LEU 37 N 0.19 -2.02 -4.75 0.55 7.99 -0.65 -1.19 117.00 117.12 1wuz n LEU 37 Ca 0.18 -1.08 -0.41 0.00 -0.01 0.00 0.00 56.01 54.69 1wuz n LEU 37 Cb 0.35 -2.14 -0.02 0.00 -0.11 0.00 0.00 43.42 41.50 1wuz n LEU 37 CO 0.16 0.52 1.17 0.12 -1.51 0.00 0.00 177.39 177.85 1wuz s PHE 38 N -3.72 2.82 -0.14 -1.77 5.36 -1.08 -2.66 117.98 116.79 1wuz s PHE 38 Ca 0.28 0.94 -0.16 0.00 -0.96 0.00 0.00 56.93 57.03 1wuz s PHE 38 Cb -0.12 -3.97 0.04 0.00 -0.34 0.00 0.00 43.02 38.64 1wuz s PHE 38 CO 0.90 -3.15 0.44 1.03 -1.46 0.00 0.00 175.22 172.98 1wuz s ARG 39 N -0.75 0.56 -0.06 10.12 1.81 -0.03 -4.99 118.95 125.61 1wuz s ARG 39 Ca 0.60 0.50 -0.03 0.00 -1.72 0.00 0.00 55.73 55.07 1wuz s ARG 39 Cb -0.45 0.27 -0.04 0.00 -0.45 0.00 0.00 34.95 34.28 1wuz s ARG 39 CO 0.49 -0.09 0.09 0.08 -0.68 0.00 0.00 175.30 175.18 1wuz s VAL 40 N -0.03 4.92 -0.00 3.52 1.01 -1.26 -0.39 120.40 128.16 1wuz s VAL 40 Ca -0.02 -0.15 -0.10 0.00 0.00 0.00 0.00 61.98 61.71 1wuz s VAL 40 Cb -0.03 -3.17 0.01 0.00 0.00 0.00 0.00 36.38 33.19 1wuz s VAL 40 CO 0.02 0.51 0.19 0.00 0.00 0.00 0.00 175.10 175.82 1wuz s ALA 41 N -1.07 -0.47 0.05 5.51 0.00 -0.60 -4.83 121.76 120.35 1wuz s ALA 41 Ca 0.18 0.00 -0.04 0.00 0.00 0.00 0.00 51.96 52.11 1wuz s ALA 41 Cb -0.12 0.11 -0.02 0.00 0.00 0.00 0.00 23.12 23.09 1wuz s ALA 41 CO 0.08 -0.23 0.05 0.45 0.00 0.00 0.00 175.76 176.11 1wuz s SER 42 N -1.40 0.31 -0.21 0.00 0.15 -1.25 -1.76 113.70 109.55 1wuz s SER 42 Ca -0.14 -0.75 -0.05 0.00 0.70 0.00 0.00 55.95 55.70 1wuz s SER 42 Cb -0.07 0.23 -0.20 0.00 -1.71 0.00 0.00 66.02 64.27 1wuz s SER 42 CO 0.02 -0.57 0.02 0.29 1.20 0.00 0.00 173.24 174.20 1wuz n LYS 43 N 0.40 0.68 0.00 5.44 5.02 -1.26 -3.42 118.16 125.01 1wuz n LYS 43 Ca -0.17 0.25 0.00 0.00 -2.02 0.00 0.00 58.31 56.37 1wuz n LYS 43 Cb 0.60 -1.61 0.00 0.00 -0.02 0.00 0.00 35.03 34.00 1wuz n LYS 43 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1wuz n ASP 44 N -3.58 0.00 -0.00 4.39 8.00 -1.26 -4.43 116.55 119.67 1wuz n ASP 44 Ca -0.41 0.75 0.02 0.00 0.71 0.00 0.00 54.79 55.86 1wuz n ASP 44 Cb 0.97 -0.25 -0.03 0.00 -0.02 0.00 0.00 41.12 41.80 1wuz n ASP 44 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 1wuz n ARG 45 N -1.55 1.30 0.00 -1.24 3.00 -1.26 -5.01 116.66 111.91 1wuz n ARG 45 Ca 0.00 -0.03 0.00 0.00 -0.01 0.00 0.00 57.85 57.81 1wuz n ARG 45 Cb 0.00 -1.00 0.00 0.00 0.00 0.00 0.00 32.46 31.46 1wuz n ARG 45 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1wuz n GLY 46 N 2.05 2.23 2.27 -0.13 0.00 -1.22 -4.90 105.19 105.49 1wuz n GLY 46 Ca -0.00 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.78 1wuz n GLY 46 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1wuz n ASP 47 N 0.00 1.16 -0.06 1.61 8.00 -1.26 -3.78 116.55 122.22 1wuz n ASP 47 Ca 0.00 -2.95 -0.22 0.00 0.71 0.00 0.00 54.79 52.33 1wuz n ASP 47 Cb 0.00 -0.63 -0.13 0.00 -0.02 0.00 0.00 41.12 40.34 1wuz n ASP 47 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1wuz n LEU 48 N 0.95 2.34 -3.69 0.64 4.77 -1.26 -4.32 117.00 116.43 1wuz n LEU 48 Ca 0.24 0.27 -0.14 0.00 -0.03 0.00 0.00 56.01 56.35 1wuz n LEU 48 Cb 0.53 -1.03 -0.08 0.00 -2.33 0.00 0.00 43.42 40.52 1wuz n LEU 48 CO 0.23 0.63 0.13 -0.76 -1.33 0.00 0.00 177.39 176.30 1wuz s LEU 49 N -7.33 0.45 0.02 2.23 1.02 -1.26 -2.06 118.68 111.75 1wuz s LEU 49 Ca -0.27 0.18 0.03 0.00 0.02 0.00 0.00 54.13 54.09 1wuz s LEU 49 Cb 0.07 1.63 -0.01 0.00 0.02 0.00 0.00 46.19 47.90 1wuz s LEU 49 CO 0.67 -0.54 -0.10 -1.61 0.02 0.00 0.00 176.35 174.80 1wuz s GLU 50 N -1.61 0.72 0.07 1.70 2.02 -1.04 -4.86 118.70 115.69 1wuz s GLU 50 Ca -0.11 -0.51 -0.12 0.00 0.02 0.00 0.00 54.97 54.25 1wuz s GLU 50 Cb -0.03 -0.66 -0.06 0.00 0.10 0.00 0.00 34.13 33.48 1wuz s GLU 50 CO 0.04 0.17 0.42 0.54 0.02 0.00 0.00 175.26 176.45 1wuz s VAL 51 N -0.60 5.05 -0.35 2.63 0.11 -1.26 -2.08 120.40 123.90 1wuz s VAL 51 Ca 0.00 0.60 -0.13 0.00 -2.93 0.00 0.00 61.98 59.53 1wuz s VAL 51 Cb -0.06 -3.67 -0.01 0.00 -1.53 0.00 0.00 36.38 31.11 1wuz s VAL 51 CO 0.00 0.36 0.24 0.21 -3.33 0.00 0.00 175.10 172.58 1wuz s ASN 52 N -1.58 6.01 0.41 3.54 2.47 0.56 -4.94 114.94 121.41 1wuz s ASN 52 Ca 0.31 -0.50 0.28 0.00 0.42 0.00 0.00 52.86 53.37 1wuz s ASN 52 Cb -0.15 -2.12 1.47 0.00 -1.45 0.00 0.00 41.25 39.00 1wuz s ASN 52 CO 0.17 -0.26 1.85 -0.07 -3.72 0.00 0.00 177.10 175.07 1wuz h LEU 53 N 8.49 0.00 -0.48 3.21 3.38 -1.95 0.30 115.31 128.26 1wuz h LEU 53 Ca -0.31 0.00 0.10 0.00 0.09 0.00 0.00 57.88 57.76 1wuz h LEU 53 Cb 1.15 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.82 1wuz h LEU 53 CO 0.64 0.00 -0.03 -0.61 0.09 0.00 0.00 178.44 178.53 1wuz h GLN 54 N 0.00 0.08 0.00 1.13 5.75 -1.94 -3.31 115.11 116.82 1wuz h GLN 54 Ca 0.00 -0.00 -0.05 0.00 -0.15 0.00 0.00 58.65 58.44 1wuz h GLN 54 Cb 0.05 -0.02 -0.11 0.00 1.07 0.00 0.00 27.48 28.48 1wuz h GLN 54 CO 0.00 0.05 -0.57 -1.71 -2.65 0.00 0.00 178.83 173.95 1wuz n ASN 55 N -5.26 0.21 -2.54 -0.69 5.15 -1.06 -4.99 115.26 106.08 1wuz n ASN 55 Ca 0.05 -1.89 -0.18 0.00 -0.60 0.00 0.00 54.58 51.96 1wuz n ASN 55 Cb 0.26 -0.18 -0.00 0.00 -0.53 0.00 0.00 39.78 39.33 1wuz n ASN 55 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1wuz n GLY 56 N 0.13 -0.50 3.88 8.20 0.00 0.10 -4.96 105.19 112.05 1wuz n GLY 56 Ca 0.00 0.02 -0.33 0.00 0.00 0.00 0.00 46.02 45.71 1wuz n GLY 56 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1wuz s ILE 57 N -2.88 5.12 -0.26 -0.61 1.10 -1.09 -3.34 121.20 119.23 1wuz s ILE 57 Ca 0.05 0.22 -0.14 0.00 -0.51 0.00 0.00 60.65 60.28 1wuz s ILE 57 Cb -0.03 -3.63 -0.04 0.00 0.15 0.00 0.00 42.46 38.92 1wuz s ILE 57 CO 0.07 0.12 0.33 -0.22 -2.11 0.00 0.00 174.94 173.12 1wuz s LEU 58 N -2.41 4.05 0.01 8.50 1.98 -0.33 -0.32 118.68 130.16 1wuz s LEU 58 Ca 0.39 0.24 0.06 0.00 -2.89 0.00 0.00 54.13 51.93 1wuz s LEU 58 Cb -0.13 -2.36 -0.03 0.00 0.66 0.00 0.00 46.19 44.34 1wuz s LEU 58 CO 0.22 -0.14 -0.18 0.72 -1.89 0.00 0.00 176.35 175.08 1wuz s PHE 59 N 1.90 2.57 0.49 5.38 -0.12 -0.88 -1.17 117.98 126.14 1wuz s PHE 59 Ca 0.13 -0.25 -0.23 0.00 -0.05 0.00 0.00 56.93 56.53 1wuz s PHE 59 Cb -0.16 -1.51 -0.07 0.00 -0.63 0.00 0.00 43.02 40.66 1wuz s PHE 59 CO 0.10 0.20 1.36 0.08 -0.05 0.00 0.00 175.22 176.90 1wuz s VAL 60 N -0.84 2.23 -0.35 -2.49 1.01 -0.43 -2.51 120.40 117.02 1wuz s VAL 60 Ca 0.13 0.19 0.14 0.00 0.00 0.00 0.00 61.98 62.44 1wuz s VAL 60 Cb -0.10 -3.10 0.43 0.00 0.00 0.00 0.00 36.38 33.60 1wuz s VAL 60 CO 0.03 0.01 1.13 -3.20 0.00 0.00 0.00 175.10 173.07 1wuz n ASN 61 N -0.57 -0.00 -3.60 3.32 2.85 -0.87 -1.98 115.26 114.40 1wuz n ASN 61 Ca 0.08 -2.60 -0.00 0.00 -0.11 0.00 0.00 54.58 51.95 1wuz n ASN 61 Cb 0.44 0.14 -0.01 0.00 1.24 0.00 0.00 39.78 41.59 1wuz n ASN 61 CO 0.00 0.00 0.00 -0.55 -2.11 0.00 0.00 177.26 174.60 1wuz s SER 62 N -2.30 -0.04 0.03 1.20 0.15 -1.12 -4.02 113.70 107.60 1wuz s SER 62 Ca 0.25 -0.03 -0.30 0.00 0.70 0.00 0.00 55.95 56.57 1wuz s SER 62 Cb 0.43 0.06 -0.06 0.00 -1.71 0.00 0.00 66.02 64.74 1wuz s SER 62 CO -0.02 -0.11 1.48 0.00 1.20 0.00 0.00 173.24 175.79 1wuz s ARG 63 N -2.18 4.26 -0.02 5.44 1.70 -1.26 -4.86 118.95 122.03 1wuz s ARG 63 Ca 0.13 2.09 0.13 0.00 -0.47 0.00 0.00 55.73 57.60 1wuz s ARG 63 Cb 0.03 -3.57 -0.19 0.00 -0.57 0.00 0.00 34.95 30.64 1wuz s ARG 63 CO -0.04 -0.62 0.32 -0.89 -1.08 0.00 0.00 175.30 172.98 1wuz n ILE 64 N 4.66 0.00 -1.56 4.99 2.08 -1.26 -4.11 119.36 124.17 1wuz n ILE 64 Ca 0.14 -0.28 -0.48 0.00 0.56 0.00 0.00 62.75 62.69 1wuz n ILE 64 Cb 0.43 0.31 -0.03 0.00 -0.75 0.00 0.00 39.64 39.59 1wuz n ILE 64 CO 0.00 0.00 0.00 -0.67 0.56 0.00 0.00 176.55 176.44 1wuz n ASP 65 N -1.87 0.96 0.21 4.38 -0.08 -1.26 -3.99 116.55 114.91 1wuz n ASP 65 Ca -0.02 1.15 0.18 0.00 -1.51 0.00 0.00 54.79 54.59 1wuz n ASP 65 Cb 0.32 -1.20 0.79 0.00 2.34 0.00 0.00 41.12 43.37 1wuz n ASP 65 CO 0.00 0.00 0.00 0.08 0.12 0.00 0.00 177.20 177.40 1wuz h ARG 66 N 2.61 0.00 0.47 -0.67 0.11 -1.95 0.73 114.38 115.69 1wuz h ARG 66 Ca -0.40 0.00 -0.02 0.00 0.10 0.00 0.00 59.98 59.65 1wuz h ARG 66 Cb 1.36 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.44 1wuz h ARG 66 CO 0.65 0.00 -0.23 1.49 0.10 0.00 0.00 179.97 181.98 1wuz h GLU 67 N 0.00 -0.61 0.00 0.08 4.81 -1.86 0.37 114.58 117.37 1wuz h GLU 67 Ca 0.10 0.04 -0.05 0.00 -0.13 0.00 0.00 59.36 59.32 1wuz h GLU 67 Cb 0.84 0.14 -0.01 0.00 0.63 0.00 0.00 28.75 30.35 1wuz h GLU 67 CO -0.00 -0.31 -0.29 0.93 -0.73 0.00 0.00 179.01 178.61 1wuz h GLU 68 N -1.02 0.00 0.00 1.92 5.08 -1.68 -3.40 114.58 115.48 1wuz h GLU 68 Ca -0.06 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1wuz h GLU 68 Cb 0.58 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.83 1wuz h GLU 68 CO 0.11 0.98 0.00 -0.11 -1.00 0.00 0.00 179.01 178.98 1wuz n LEU 69 N -4.57 0.00 0.11 1.33 7.94 0.25 -4.90 117.00 117.16 1wuz n LEU 69 Ca -0.15 0.88 0.00 0.00 -1.11 0.00 0.00 56.01 55.63 1wuz n LEU 69 Cb 0.52 -0.38 0.00 0.00 0.53 0.00 0.00 43.42 44.09 1wuz n LEU 69 CO 0.30 -0.38 0.00 0.00 -1.11 0.00 0.00 177.39 176.20 1wuz n GLY 71 N -1.42 0.71 0.00 0.00 0.00 0.13 -4.77 105.19 99.84 1wuz n GLY 71 Ca 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.94 1wuz n GLY 71 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1wuz n ARG 72 N -0.83 0.00 -4.07 1.61 1.74 -1.26 -4.94 116.66 108.91 1wuz n ARG 72 Ca -0.07 0.26 -0.24 0.00 -0.77 0.00 0.00 57.85 57.04 1wuz n ARG 72 Cb 0.46 -0.88 -0.04 0.00 -1.02 0.00 0.00 32.46 30.98 1wuz n ARG 72 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1wuz s SER 73 N -2.04 5.71 0.60 0.55 0.15 -1.26 -4.99 113.70 112.43 1wuz s SER 73 Ca 0.00 -0.13 0.30 0.00 0.70 0.00 0.00 55.95 56.82 1wuz s SER 73 Cb 0.00 -1.53 1.68 0.00 -1.71 0.00 0.00 66.02 64.47 1wuz s SER 73 CO 0.00 0.00 2.07 0.00 1.20 0.00 0.00 173.24 176.51 1wuz h ALA 74 N 1.81 1.74 -3.47 5.45 0.00 -1.92 -3.37 119.26 119.51 1wuz h ALA 74 Ca -0.49 -0.01 -0.64 0.00 0.00 0.00 0.00 54.91 53.78 1wuz h ALA 74 Cb 1.22 0.01 -0.37 0.00 0.00 0.00 0.00 17.79 18.66 1wuz h ALA 74 CO 0.62 -0.34 -0.82 -1.83 0.00 0.00 0.00 179.25 176.88 1wuz s GLU 75 N -4.53 2.25 -0.18 0.00 -1.05 -1.26 -4.47 118.70 109.46 1wuz s GLU 75 Ca -0.04 -0.97 -0.03 0.00 -0.15 0.00 0.00 54.97 53.78 1wuz s GLU 75 Cb 0.14 -2.56 -0.02 0.00 -0.44 0.00 0.00 34.13 31.25 1wuz s GLU 75 CO 0.50 -0.42 -0.07 0.00 0.95 0.00 0.00 175.26 176.22 1wuz s SER 77 N 0.85 6.39 -0.01 0.00 0.01 -1.26 -2.41 113.70 117.27 1wuz s SER 77 Ca -0.02 0.37 0.04 0.00 1.31 0.00 0.00 55.95 57.65 1wuz s SER 77 Cb -0.15 -2.01 -0.01 0.00 0.21 0.00 0.00 66.02 64.06 1wuz s SER 77 CO 0.01 0.24 -0.13 -0.63 0.41 0.00 0.00 173.24 173.14 1wuz s ILE 78 N -1.36 1.01 -0.02 1.44 1.09 -0.59 -5.02 121.20 117.75 1wuz s ILE 78 Ca 0.29 -0.55 0.04 0.00 -1.10 0.00 0.00 60.65 59.34 1wuz s ILE 78 Cb -0.13 -0.84 -0.03 0.00 -1.06 0.00 0.00 42.46 40.40 1wuz s ILE 78 CO 0.20 0.28 -0.15 -1.00 -0.10 0.00 0.00 174.94 174.18 1wuz s HIS 79 N -0.30 2.68 0.05 3.97 3.76 -1.26 -1.97 115.29 122.22 1wuz s HIS 79 Ca 0.05 -0.18 -0.07 0.00 -0.15 0.00 0.00 55.06 54.72 1wuz s HIS 79 Cb -0.05 -1.59 -0.01 0.00 1.11 0.00 0.00 32.58 32.05 1wuz s HIS 79 CO -0.00 0.21 0.13 -1.17 -0.85 0.00 0.00 174.74 173.06 1wuz s LEU 80 N -0.95 1.67 -0.16 0.89 0.20 0.77 -4.75 118.68 116.36 1wuz s LEU 80 Ca 0.13 -0.59 -0.01 0.00 0.69 0.00 0.00 54.13 54.35 1wuz s LEU 80 Cb -0.11 0.76 0.05 0.00 -0.43 0.00 0.00 46.19 46.46 1wuz s LEU 80 CO 0.02 -0.60 -0.02 -1.61 -0.29 0.00 0.00 176.35 173.86 1wuz s GLU 81 N -3.13 1.06 -0.47 1.98 2.02 -0.72 -1.83 118.70 117.61 1wuz s GLU 81 Ca -0.01 -0.41 -0.21 0.00 0.02 0.00 0.00 54.97 54.37 1wuz s GLU 81 Cb 0.02 -1.89 0.03 0.00 0.10 0.00 0.00 34.13 32.39 1wuz s GLU 81 CO -0.07 -0.48 0.70 0.08 0.02 0.00 0.00 175.26 175.51 1wuz s VAL 82 N 1.75 4.75 -0.02 2.63 1.01 -0.92 -1.56 120.40 128.04 1wuz s VAL 82 Ca 0.01 0.04 -0.26 0.00 0.00 0.00 0.00 61.98 61.76 1wuz s VAL 82 Cb -0.15 -4.29 -0.04 0.00 0.00 0.00 0.00 36.38 31.90 1wuz s VAL 82 CO -0.07 -0.73 0.82 -0.51 0.00 0.00 0.00 175.10 174.60 1wuz s ILE 83 N 3.00 4.92 0.01 2.22 -1.16 0.48 -0.99 121.20 129.68 1wuz s ILE 83 Ca 0.23 1.71 0.05 0.00 -0.51 0.00 0.00 60.65 62.14 1wuz s ILE 83 Cb -0.15 -4.16 -0.02 0.00 0.61 0.00 0.00 42.46 38.74 1wuz s ILE 83 CO 0.18 0.24 -0.16 0.68 -2.81 0.00 0.00 174.94 173.06 1wuz s VAL 84 N 0.73 1.27 -0.27 4.00 -7.23 -0.44 -0.85 120.40 117.61 1wuz s VAL 84 Ca 0.43 -0.87 -0.06 0.00 -1.81 0.00 0.00 61.98 59.67 1wuz s VAL 84 Cb -0.19 -1.09 0.00 0.00 0.56 0.00 0.00 36.38 35.65 1wuz s VAL 84 CO 0.23 0.21 0.05 -0.62 -0.31 0.00 0.00 175.10 174.66 1wuz s ASP 85 N -0.76 4.93 -0.24 4.85 2.15 -0.33 -2.46 116.67 124.81 1wuz s ASP 85 Ca 0.05 -0.62 -0.06 0.00 0.43 0.00 0.00 52.55 52.35 1wuz s ASP 85 Cb -0.07 -1.84 0.01 0.00 -0.30 0.00 0.00 42.92 40.71 1wuz s ASP 85 CO 0.00 -0.14 0.21 0.54 -0.17 0.00 0.00 175.17 175.61 1wuz n ARG 86 N 4.84 -1.81 -1.41 4.34 5.12 -1.26 -3.36 116.66 123.12 1wuz n ARG 86 Ca -0.15 1.71 -0.32 0.00 -1.93 0.00 0.00 57.85 57.16 1wuz n ARG 86 Cb 0.49 -3.97 0.08 0.00 -1.16 0.00 0.00 32.46 27.89 1wuz n ARG 86 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 1wuz s PRO 87 N -1.58 2.41 -0.46 5.56 0.04 -1.26 -4.22 135.00 135.48 1wuz s PRO 87 Ca 0.09 1.23 -0.20 0.00 0.04 0.00 0.00 61.00 62.16 1wuz s PRO 87 Cb -0.02 -1.91 0.03 0.00 0.04 0.00 0.00 34.50 32.64 1wuz s PRO 87 CO 0.49 -1.53 0.64 -0.51 0.04 0.00 0.00 177.00 176.13 1wuz s LEU 88 N -5.61 4.64 0.00 -3.56 1.02 -1.26 -4.66 118.68 109.25 1wuz s LEU 88 Ca 0.63 -0.54 -0.10 0.00 0.02 0.00 0.00 54.13 54.14 1wuz s LEU 88 Cb -0.18 -2.62 0.03 0.00 0.02 0.00 0.00 46.19 43.44 1wuz s LEU 88 CO 0.52 -0.82 0.45 0.00 0.02 0.00 0.00 176.35 176.52 1wuz n GLN 89 N 6.26 0.04 -4.27 1.70 1.13 -1.03 -5.04 117.38 116.16 1wuz n GLN 89 Ca -0.03 -0.23 -0.18 0.00 -1.94 0.00 0.00 57.00 54.62 1wuz n GLN 89 Cb 0.47 0.40 -0.11 0.00 0.11 0.00 0.00 30.24 31.11 1wuz n GLN 89 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 1wuz s VAL 90 N -2.06 1.44 -0.15 5.09 1.01 -1.26 -1.32 120.40 123.15 1wuz s VAL 90 Ca 0.11 -1.89 0.00 0.00 0.00 0.00 0.00 61.98 60.20 1wuz s VAL 90 Cb -0.00 -1.71 -0.00 0.00 0.00 0.00 0.00 36.38 34.66 1wuz s VAL 90 CO -0.01 -0.49 -0.15 -0.36 0.00 0.00 0.00 175.10 174.10 1wuz s PHE 91 N -2.46 2.78 -0.05 5.22 0.08 -0.16 -4.92 117.98 118.47 1wuz s PHE 91 Ca 0.13 -0.95 -0.30 0.00 0.12 0.00 0.00 56.93 55.94 1wuz s PHE 91 Cb -0.03 -1.87 -0.05 0.00 -0.57 0.00 0.00 43.02 40.50 1wuz s PHE 91 CO 0.04 -0.41 1.52 -1.58 -0.10 0.00 0.00 175.22 174.68 1wuz s HIS 92 N 0.69 2.40 -0.07 0.36 2.46 -0.44 -2.17 115.29 118.53 1wuz s HIS 92 Ca -0.07 0.51 0.02 0.00 0.47 0.00 0.00 55.06 56.00 1wuz s HIS 92 Cb -0.16 -3.78 0.01 0.00 -0.13 0.00 0.00 32.58 28.53 1wuz s HIS 92 CO 0.02 -3.09 -0.14 0.08 -2.47 0.00 0.00 174.74 169.13 1wuz s VAL 93 N 3.39 1.30 -0.15 0.89 1.01 -0.76 -1.51 120.40 124.56 1wuz s VAL 93 Ca 0.67 -0.57 -0.03 0.00 0.00 0.00 0.00 61.98 62.06 1wuz s VAL 93 Cb -0.31 -1.17 0.05 0.00 0.00 0.00 0.00 36.38 34.94 1wuz s VAL 93 CO 0.26 0.39 0.03 -0.70 0.00 0.00 0.00 175.10 175.08 1wuz s GLU 94 N 0.64 0.60 -0.15 2.72 2.12 -0.24 -0.16 118.70 124.24 1wuz s GLU 94 Ca -0.15 -0.22 -0.02 0.00 0.36 0.00 0.00 54.97 54.94 1wuz s GLU 94 Cb -0.16 -1.73 -0.02 0.00 0.26 0.00 0.00 34.13 32.48 1wuz s GLU 94 CO 0.04 -0.53 -0.07 0.14 -0.54 0.00 0.00 175.26 174.30 1wuz s VAL 95 N 1.92 3.59 0.17 3.70 -7.23 -0.83 -0.64 120.40 121.07 1wuz s VAL 95 Ca 0.01 -0.47 0.06 0.00 -1.81 0.00 0.00 61.98 59.77 1wuz s VAL 95 Cb -0.15 -2.55 -0.04 0.00 0.56 0.00 0.00 36.38 34.19 1wuz s VAL 95 CO -0.07 0.51 0.08 -0.70 -0.31 0.00 0.00 175.10 174.60 1wuz s GLU 96 N 0.34 2.71 -0.23 4.82 2.12 -1.09 -1.54 118.70 125.82 1wuz s GLU 96 Ca -0.07 -0.96 -0.10 0.00 0.36 0.00 0.00 54.97 54.21 1wuz s GLU 96 Cb -0.15 -2.54 -0.05 0.00 0.26 0.00 0.00 34.13 31.66 1wuz s GLU 96 CO 0.04 0.48 0.14 0.14 -0.54 0.00 0.00 175.26 175.51 1wuz s VAL 97 N -1.73 5.22 -0.38 3.70 -7.23 -1.01 -2.54 120.40 116.42 1wuz s VAL 97 Ca 0.29 0.13 -0.18 0.00 -1.81 0.00 0.00 61.98 60.41 1wuz s VAL 97 Cb -0.10 -3.42 0.01 0.00 0.56 0.00 0.00 36.38 33.43 1wuz s VAL 97 CO 0.21 0.37 0.52 -0.60 -0.31 0.00 0.00 175.10 175.29 1wuz s ARG 98 N 0.96 3.45 -0.04 4.82 3.00 -1.00 -4.40 118.95 125.73 1wuz s ARG 98 Ca 0.07 -0.33 -0.15 0.00 -1.00 0.00 0.00 55.73 54.32 1wuz s ARG 98 Cb -0.13 -3.87 0.05 0.00 0.00 0.00 0.00 34.95 31.00 1wuz s ARG 98 CO 0.03 -0.75 0.67 -0.25 0.00 0.00 0.00 175.30 175.00 1wuz n ASP 99 N 5.81 -0.50 -4.56 -2.12 9.92 -1.26 -2.46 116.55 121.37 1wuz n ASP 99 Ca -0.05 -1.01 -0.26 0.00 -0.53 0.00 0.00 54.79 52.94 1wuz n ASP 99 Cb 0.48 0.75 -0.09 0.00 -0.64 0.00 0.00 41.12 41.63 1wuz n ASP 99 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 1wuz s ILE 100 N -2.01 3.10 -0.11 0.53 1.09 -1.26 -4.77 121.20 117.77 1wuz s ILE 100 Ca 0.16 -1.84 -0.22 0.00 -1.10 0.00 0.00 60.65 57.65 1wuz s ILE 100 Cb -0.00 -2.57 -0.19 0.00 -1.06 0.00 0.00 42.46 38.63 1wuz s ILE 100 CO -0.01 -0.21 0.68 -1.13 -0.10 0.00 0.00 174.94 174.16 1wuz h ASN 101 N 2.61 -0.03 -0.83 3.58 -0.00 -1.89 -3.32 115.58 115.71 1wuz h ASN 101 Ca -0.45 -0.68 -0.40 0.00 -0.00 0.00 0.00 56.30 54.77 1wuz h ASN 101 Cb 1.22 0.01 -0.24 0.00 -0.00 0.00 0.00 38.32 39.31 1wuz h ASN 101 CO 0.56 0.77 0.51 0.47 -0.00 0.00 0.00 177.43 179.74 1wuz n ASP 102 N -4.71 3.84 0.00 1.15 8.00 -1.26 -4.97 116.55 118.61 1wuz n ASP 102 Ca -0.08 -3.33 0.00 0.00 0.71 0.00 0.00 54.79 52.09 1wuz n ASP 102 Cb 0.34 -0.78 0.00 0.00 -0.02 0.00 0.00 41.12 40.66 1wuz n ASP 102 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40